2-[[3-[3-[1-(1H-indol-2-yl)ethyl-methyl-amino]-3-oxidanylidene-prop-1-en-2-yl]pyridin-2-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-[3-[1-(1H-indol-2-yl)ethyl-methyl-amino]-3-oxidanylidene-prop-1-en-2-yl]pyridin-2-yl]carbamoyl]benzoic acid Openeye Name: 2-[[3-[1-[1-(1H-indol-2-yl)ethyl-methyl-carbamoyl]vinyl]-2-pyridyl]carbamoyl]benzoic acid CAS Name: 2-[[[3-[3-[1-(1H-indol-2-yl)ethyl-methylamino]-3-oxoprop-1-en-2-yl]-2-pyridinyl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[3-[3-[1-(1H-indol-2-yl)ethyl-methylamino]-3-oxoprop-1-en-2-yl]pyridin-2-yl]carbamoyl]benzoic acid Traditional Name: 2-[[3-[1-[1-(1H-indol-2-yl)ethyl-methyl-carbamoyl]vinyl]-2-pyridyl]carbamoyl]benzoic acid Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2N1)N(C)C(=O)C(=C)C3=C(N=CC=C3)NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CC(C1=CC2=CC=CC=C2N1)N(C)C(=O)C(=C)C3=C(N=CC=C3)NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C27H24N4O4/c1-16(26(33)31(3)17(2)23-15-18-9-4-7-13-22(18)29-23)19-12-8-14-28-24(19)30-25(32)20-10-5-6-11-21(20)27(34)35/h4-15,17,29H,1H2,2-3H3,(H,34,35)(H,28,30,32)