(E)-3-[1-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-[(E)-2-phenylethenyl]indol-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-[(E)-2-phenylethenyl]indol-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[1-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]-4-[(E)-styryl]indol-3-yl]prop-2-enoic acid CAS Name: (E)-3-[1-[2-[methyl(phenethyl)amino]-2-oxoethyl]-4-[(E)-2-phenylethenyl]-3-indolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-[2-[methyl(phenethyl)amino]-2-oxoethyl]-4-[(E)-2-phenylethenyl]indol-3-yl]prop-2-enoic acid Traditional Name: (E)-3-[1-[2-keto-2-[methyl(phenethyl)amino]ethyl]-4-[(E)-styryl]indol-3-yl]acrylic acid Formula: C30H28N2O3 MolecularWeight: 464.55492

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CN2C=C(C3=C(C=CC=C32)C=CC4=CC=CC=C4)C=CC(=O)O

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)CN2C=C(C3=C(C=CC=C32)/C=C/C4=CC=CC=C4)/C=C/C(=O)O

InChI

InChI=1S/C30H28N2O3/c1-31(20-19-24-11-6-3-7-12-24)28(33)22-32-21-26(17-18-29(34)35)30-25(13-8-14-27(30)32)16-15-23-9-4-2-5-10-23/h2-18,21H,19-20,22H2,1H3,(H,34,35)/b16-15+,18-17+