methyl 2-azanyl-5-[(E)-3-[1-(1H-indol-3-yl)ethyl-methyl-amino]-3-oxidanylidene-prop-1-enyl]pyridine-3-carboxylate

Systemtic Name: methyl 2-azanyl-5-[(E)-3-[1-(1H-indol-3-yl)ethyl-methyl-amino]-3-oxidanylidene-prop-1-enyl]pyridine-3-carboxylate Openeye Name: methyl 2-amino-5-[(E)-3-[1-(1H-indol-3-yl)ethyl-methyl-amino]-3-oxo-prop-1-enyl]pyridine-3-carboxylate CAS Name: 2-amino-5-[(E)-3-[1-(1H-indol-3-yl)ethyl-methylamino]-3-oxoprop-1-enyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-5-[(E)-3-[1-(1H-indol-3-yl)ethyl-methylamino]-3-oxoprop-1-enyl]pyridine-3-carboxylate Traditional Name: 2-amino-5-[(E)-3-[1-(1H-indol-3-yl)ethyl-methyl-amino]-3-keto-prop-1-enyl]nicotinic acid methyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)N(C)C(=O)C=CC3=CC(=C(N=C3)N)C(=O)OC

Isomeric SMILES

CC(C1=CNC2=CC=CC=C21)N(C)C(=O)/C=C/C3=CC(=C(N=C3)N)C(=O)OC

InChI

InChI=1S/C21H22N4O3/c1-13(17-12-23-18-7-5-4-6-15(17)18)25(2)19(26)9-8-14-10-16(21(27)28-3)20(22)24-11-14/h4-13,23H,1-3H3,(H2,22,24)/b9-8+