2-[3-[(E)-2-cyano-3-(naphthalen-2-ylamino)-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(E)-2-cyano-3-(naphthalen-2-ylamino)-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoic acid Openeye Name: 2-[3-[(E)-2-cyano-3-(2-naphthylamino)-3-oxo-prop-1-enyl]indol-1-yl]acetic acid CAS Name: 2-[3-[(E)-2-cyano-3-(2-naphthalenylamino)-3-oxoprop-1-enyl]-1-indolyl]acetic acid IUPAC Name: 2-[3-[(E)-2-cyano-3-(naphthalen-2-ylamino)-3-oxoprop-1-enyl]indol-1-yl]acetic acid Traditional Name: 2-[3-[(E)-2-cyano-3-keto-3-(2-naphthylamino)prop-1-enyl]indol-1-yl]acetic acid Formula: C24H17N3O3 MolecularWeight: 395.41008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)O)C#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC(=O)O)/C#N

InChI

InChI=1S/C24H17N3O3/c25-13-18(24(30)26-20-10-9-16-5-1-2-6-17(16)12-20)11-19-14-27(15-23(28)29)22-8-4-3-7-21(19)22/h1-12,14H,15H2,(H,26,30)(H,28,29)/b18-11+