methyl 4-azanyl-3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butylcarbamoyl]benzoate

Systemtic Name: methyl 4-azanyl-3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butylcarbamoyl]benzoate Openeye Name: methyl 4-amino-3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butylcarbamoyl]benzoate CAS Name: 4-amino-3-[oxo-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butylcarbamoyl]benzoate Traditional Name: 4-amino-3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butylcarbamoyl]benzoic acid methyl ester Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N)C(=O)NCCCCN2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N)C(=O)NCCCCN2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O3/c1-30-24(29)20-9-10-22(25)21(17-20)23(28)26-13-5-6-14-27-15-11-19(12-16-27)18-7-3-2-4-8-18/h2-4,7-11,17H,5-6,12-16,25H2,1H3,(H,26,28)