3-[[(Z)-2-benzamido-3-(1H-indol-2-yl)prop-2-enoyl]amino]-4-methoxy-benzoic acid

Systemtic Name: 3-[[(Z)-2-benzamido-3-(1H-indol-2-yl)prop-2-enoyl]amino]-4-methoxy-benzoic acid Openeye Name: 3-[[(Z)-2-benzamido-3-(1H-indol-2-yl)prop-2-enoyl]amino]-4-methoxy-benzoic acid CAS Name: 3-[[(Z)-2-benzamido-3-(1H-indol-2-yl)-1-oxoprop-2-enyl]amino]-4-methoxybenzoic acid IUPAC Name: 3-[[(Z)-2-benzamido-3-(1H-indol-2-yl)prop-2-enoyl]amino]-4-methoxybenzoic acid Traditional Name: 3-[[(Z)-2-benzamido-3-(1H-indol-2-yl)acryloyl]amino]-4-methoxy-benzoic acid Formula: C26H21N3O5 MolecularWeight: 455.46204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)NC(=O)C(=CC2=CC3=CC=CC=C3N2)NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)NC(=O)/C(=C/C2=CC3=CC=CC=C3N2)/NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H21N3O5/c1-34-23-12-11-18(26(32)33)14-21(23)28-25(31)22(29-24(30)16-7-3-2-4-8-16)15-19-13-17-9-5-6-10-20(17)27-19/h2-15,27H,1H3,(H,28,31)(H,29,30)(H,32,33)/b22-15-