methyl (2S)-3-indol-1-yl-2-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]propanoate

Systemtic Name: methyl (2S)-3-indol-1-yl-2-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]propanoate Openeye Name: methyl (2S)-3-indol-1-yl-2-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]propanoate CAS Name: (2S)-3-(1-indolyl)-2-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-indol-1-yl-2-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]propanoate Traditional Name: (2S)-3-indol-1-yl-2-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]propionic acid methyl ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1C=CC2=CC=CC=C21)NC=C3C=CC(=O)C=C3

Isomeric SMILES

COC(=O)[C@H](CN1C=CC2=CC=CC=C21)NC=C3C=CC(=O)C=C3

InChI

InChI=1S/C19H18N2O3/c1-24-19(23)17(20-12-14-6-8-16(22)9-7-14)13-21-11-10-15-4-2-3-5-18(15)21/h2-12,17,20H,13H2,1H3/t17-/m0/s1