3-[[(E)-2-benzamido-3-(9-methylcarbazol-3-yl)prop-2-enoyl]amino]propanoic acid

Systemtic Name: 3-[[(E)-2-benzamido-3-(9-methylcarbazol-3-yl)prop-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(E)-2-benzamido-3-(9-methylcarbazol-3-yl)prop-2-enoyl]amino]propanoic acid CAS Name: 3-[[(E)-2-benzamido-3-(9-methyl-3-carbazolyl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-2-benzamido-3-(9-methylcarbazol-3-yl)prop-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(E)-2-benzamido-3-(9-methylcarbazol-3-yl)acryloyl]amino]propionic acid Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C=C(C(=O)NCCC(=O)O)NC(=O)C3=CC=CC=C3)C4=CC=CC=C41

Isomeric SMILES

CN1C2=C(C=C(C=C2)/C=C(\C(=O)NCCC(=O)O)/NC(=O)C3=CC=CC=C3)C4=CC=CC=C41

InChI

InChI=1S/C26H23N3O4/c1-29-22-10-6-5-9-19(22)20-15-17(11-12-23(20)29)16-21(26(33)27-14-13-24(30)31)28-25(32)18-7-3-2-4-8-18/h2-12,15-16H,13-14H2,1H3,(H,27,33)(H,28,32)(H,30,31)/b21-16+