methyl 2-azanyl-4-methyl-6-oxidanylidene-6-[6-phenyl-6-(pyridin-4-ylmethylamino)cyclohexa-2,4-dien-1-yl]hexanoate

Systemtic Name: methyl 2-azanyl-4-methyl-6-oxidanylidene-6-[6-phenyl-6-(pyridin-4-ylmethylamino)cyclohexa-2,4-dien-1-yl]hexanoate Openeye Name: methyl 2-amino-4-methyl-6-oxo-6-[6-phenyl-6-(4-pyridylmethylamino)cyclohexa-2,4-dien-1-yl]hexanoate CAS Name: 2-amino-4-methyl-6-oxo-6-[6-phenyl-6-(pyridin-4-ylmethylamino)-1-cyclohexa-2,4-dienyl]hexanoic acid methyl ester IUPAC Name: methyl 2-amino-4-methyl-6-oxo-6-[6-phenyl-6-(pyridin-4-ylmethylamino)cyclohexa-2,4-dien-1-yl]hexanoate Traditional Name: 2-amino-6-keto-4-methyl-6-[6-phenyl-6-(4-pyridylmethylamino)cyclohexa-2,4-dien-1-yl]hexanoic acid methyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)OC)N)CC(=O)C1C=CC=CC1(C2=CC=CC=C2)NCC3=CC=NC=C3

Isomeric SMILES

CC(CC(C(=O)OC)N)CC(=O)C1C=CC=CC1(C2=CC=CC=C2)NCC3=CC=NC=C3

InChI

InChI=1S/C26H31N3O3/c1-19(16-23(27)25(31)32-2)17-24(30)22-10-6-7-13-26(22,21-8-4-3-5-9-21)29-18-20-11-14-28-15-12-20/h3-15,19,22-23,29H,16-18,27H2,1-2H3