[4-[(E)-[4-(2-dimethylaminoethyloxy)phenyl]-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)methyl]phenyl] benzoate

Systemtic Name: [4-[(E)-[4-(2-dimethylaminoethyloxy)phenyl]-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)methyl]phenyl] benzoate Openeye Name: [4-[(E)-[4-(2-dimethylaminoethyloxy)phenyl]-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)methyl]phenyl] benzoate CAS Name: benzoic acid [4-[(E)-[4-(2-dimethylaminoethyloxy)phenyl]-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-[4-(2-dimethylaminoethyloxy)phenyl]-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)methyl]phenyl] benzoate Traditional Name: benzoic acid [4-[(E)-[4-(2-dimethylaminoethyloxy)phenyl]-(6,7,8,9-tetrahydrobenzocyclohepten-5-ylidene)methyl]phenyl] ester Formula: C35H35NO3 MolecularWeight: 517.6573

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC=C(C=C1)C(=C2CCCCC3=CC=CC=C32)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CN(C)CCOC1=CC=C(C=C1)/C(=C\2/CCCCC3=CC=CC=C32)/C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C35H35NO3/c1-36(2)24-25-38-30-20-16-27(17-21-30)34(33-15-9-7-11-26-10-6-8-14-32(26)33)28-18-22-31(23-19-28)39-35(37)29-12-4-3-5-13-29/h3-6,8,10,12-14,16-23H,7,9,11,15,24-25H2,1-2H3/b34-33+