4-[[(E,4E)-3-methyl-4-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)but-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[[(E,4E)-3-methyl-4-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)but-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(E,4E)-3-methyl-4-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)but-2-enoyl]amino]benzoic acid CAS Name: 4-[[(E,4E)-3-methyl-1-oxo-4-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)but-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(E,4E)-3-methyl-4-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)but-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E,4E)-3-methyl-4-(6,7,8,9-tetrahydrobenzocyclohepten-5-ylidene)but-2-enoyl]amino]benzoic acid Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC=C(C=C1)C(=O)O)C=C2CCCCC3=CC=CC=C32

Isomeric SMILES

C/C(=C\C(=O)NC1=CC=C(C=C1)C(=O)O)/C=C/2\CCCCC3=CC=CC=C32

InChI

InChI=1S/C23H23NO3/c1-16(14-19-8-3-2-6-17-7-4-5-9-21(17)19)15-22(25)24-20-12-10-18(11-13-20)23(26)27/h4-5,7,9-15H,2-3,6,8H2,1H3,(H,24,25)(H,26,27)/b16-15+,19-14+