2-[3-[(E)-2-cyano-3-[(9-ethylcarbazol-3-yl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(E)-2-cyano-3-[(9-ethylcarbazol-3-yl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoic acid Openeye Name: 2-[3-[(E)-2-cyano-3-[(9-ethylcarbazol-3-yl)amino]-3-oxo-prop-1-enyl]indol-1-yl]acetic acid CAS Name: 2-[3-[(E)-2-cyano-3-[(9-ethyl-3-carbazolyl)amino]-3-oxoprop-1-enyl]-1-indolyl]acetic acid IUPAC Name: 2-[3-[(E)-2-cyano-3-[(9-ethylcarbazol-3-yl)amino]-3-oxoprop-1-enyl]indol-1-yl]acetic acid Traditional Name: 2-[3-[(E)-2-cyano-3-[(9-ethylcarbazol-3-yl)amino]-3-keto-prop-1-enyl]indol-1-yl]acetic acid Formula: C28H22N4O3 MolecularWeight: 462.49928

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)O)C#N)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC(=O)O)/C#N)C5=CC=CC=C51

InChI

InChI=1S/C28H22N4O3/c1-2-32-25-10-6-4-8-22(25)23-14-20(11-12-26(23)32)30-28(35)18(15-29)13-19-16-31(17-27(33)34)24-9-5-3-7-21(19)24/h3-14,16H,2,17H2,1H3,(H,30,35)(H,33,34)/b18-13+