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2-[3-[2-(3-methylbutylamino)-1-oxidanyl-ethyl]-5,8-bis(oxidanylidene)-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-6-yl]ethanamide

2-[3-[2-(3-methylbutylamino)-1-oxidanyl-ethyl]-5,8-bis(oxidanylidene)-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-6-yl]ethanamide

Systemtic Name:2-[3-[2-(3-methylbutylamino)-1-oxidanyl-ethyl]-5,8-bis(oxidanylidene)-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-6-yl]ethanamide
Openeye Name:2-[3-[1-hydroxy-2-(isopentylamino)ethyl]-5,8-dioxo-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-6-yl]acetamide
CAS Name:2-[3-[1-hydroxy-2-(3-methylbutylamino)ethyl]-5,8-dioxo-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-6-yl]acetamide
IUPAC Name:2-[3-[1-hydroxy-2-(3-methylbutylamino)ethyl]-5,8-dioxo-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-6-yl]acetamide
Traditional Name:2-[3-[1-hydroxy-2-(isoamylamino)ethyl]-5,8-diketo-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-6-yl]acetamide
Formula: C23H36N4O5
MolecularWeight: 448.55574
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC(C1CC2=CC=C(C=C2)OCCCC(=O)NC(C(=O)N1)CC(=O)N)O


Isomeric SMILES

CC(C)CCNCC(C1CC2=CC=C(C=C2)OCCCC(=O)NC(C(=O)N1)CC(=O)N)O


InChI

InChI=1S/C23H36N4O5/c1-15(2)9-10-25-14-20(28)18-12-16-5-7-17(8-6-16)32-11-3-4-22(30)26-19(13-21(24)29)23(31)27-18/h5-8,15,18-20,25,28H,3-4,9-14H2,1-2H3,(H2,24,29)(H,26,30)(H,27,31)


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