4-azanyl-2-(1-azanyl-2-phenyl-ethyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methyl-2-oxidanyl-heptane-1,3-dione

Systemtic Name: 4-azanyl-2-(1-azanyl-2-phenyl-ethyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methyl-2-oxidanyl-heptane-1,3-dione Openeye Name: 4-amino-2-(1-amino-2-phenyl-ethyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-6-methyl-heptane-1,3-dione CAS Name: 4-amino-2-(1-amino-2-phenylethyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-6-methylheptane-1,3-dione IUPAC Name: 4-amino-2-(1-amino-2-phenylethyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-6-methylheptane-1,3-dione Traditional Name: 4-amino-2-(1-amino-2-phenyl-ethyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-6-methyl-heptane-1,3-dione Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(C(CC1=CC=CC=C1)N)(C(=O)N2CCC3=CC=CC=C3C2)O)N

Isomeric SMILES

CC(C)CC(C(=O)C(C(CC1=CC=CC=C1)N)(C(=O)N2CCC3=CC=CC=C3C2)O)N

InChI

InChI=1S/C25H33N3O3/c1-17(2)14-21(26)23(29)25(31,22(27)15-18-8-4-3-5-9-18)24(30)28-13-12-19-10-6-7-11-20(19)16-28/h3-11,17,21-22,31H,12-16,26-27H2,1-2H3