2-azanyl-N-[6,9-bis(azanyl)-5,10-dicyclohexyl-2-methyl-7,8-bis(oxidanyl)-4-oxidanylidene-decan-3-yl]-3-phenyl-propanamide

Systemtic Name: 2-azanyl-N-[6,9-bis(azanyl)-5,10-dicyclohexyl-2-methyl-7,8-bis(oxidanyl)-4-oxidanylidene-decan-3-yl]-3-phenyl-propanamide Openeye Name: 2-amino-N-(4,7-diamino-3,8-dicyclohexyl-5,6-dihydroxy-1-isopropyl-2-oxo-octyl)-3-phenyl-propanamide CAS Name: 2-amino-N-(6,9-diamino-5,10-dicyclohexyl-7,8-dihydroxy-2-methyl-4-oxodecan-3-yl)-3-phenylpropanamide IUPAC Name: 2-amino-N-(6,9-diamino-5,10-dicyclohexyl-7,8-dihydroxy-2-methyl-4-oxodecan-3-yl)-3-phenylpropanamide Traditional Name: 2-amino-N-(4,7-diamino-3,8-dicyclohexyl-5,6-dihydroxy-1-isopropyl-2-keto-octyl)-3-phenyl-propionamide Formula: C32H54N4O4 MolecularWeight: 558.79556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(C1CCCCC1)C(C(C(C(CC2CCCCC2)N)O)O)N)NC(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)C(C(=O)C(C1CCCCC1)C(C(C(C(CC2CCCCC2)N)O)O)N)NC(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C32H54N4O4/c1-20(2)28(36-32(40)25(34)19-22-14-8-4-9-15-22)30(38)26(23-16-10-5-11-17-23)27(35)31(39)29(37)24(33)18-21-12-6-3-7-13-21/h4,8-9,14-15,20-21,23-29,31,37,39H,3,5-7,10-13,16-19,33-35H2,1-2H3,(H,36,40)