3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid Openeye Name: 3-[(E)-3-anilino-3-oxo-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid IUPAC Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(N2)C(=O)O)C=CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(C1)C(=C(N2)C(=O)O)/C=C/C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3/c21-16(19-12-6-2-1-3-7-12)11-10-14-13-8-4-5-9-15(13)20-17(14)18(22)23/h1-3,6-7,10-11,20H,4-5,8-9H2,(H,19,21)(H,22,23)/b11-10+