(2S)-3-(1H-indol-3-yl)-2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]propanoic acid

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]propanoic acid Openeye Name: (2S)-3-(1H-indol-3-yl)-2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]propanoic acid CAS Name: (2S)-3-(1H-indol-3-yl)-2-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]propanoic acid IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]propanoic acid Traditional Name: (2S)-3-(1H-indol-3-yl)-2-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]propionic acid Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC=C3C=CC=CC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)NC=C3C=CC=CC3=O

InChI

InChI=1S/C18H16N2O3/c21-17-8-4-1-5-12(17)10-20-16(18(22)23)9-13-11-19-15-7-3-2-6-14(13)15/h1-8,10-11,16,19-20H,9H2,(H,22,23)/t16-/m0/s1