7-[4-(2-methylphenyl)piperidin-1-yl]-9-(oxidanylidenemethylidene)-1-prop-2-enyl-7,8-dihydro-6H-benzo[7]annulen-5-one

Systemtic Name: 7-[4-(2-methylphenyl)piperidin-1-yl]-9-(oxidanylidenemethylidene)-1-prop-2-enyl-7,8-dihydro-6H-benzo[7]annulen-5-one Openeye Name: 1-allyl-7-[4-(o-tolyl)-1-piperidyl]-9-(oxomethylene)-7,8-dihydro-6H-benzo[7]annulen-5-one CAS Name: 7-[4-(2-methylphenyl)-1-piperidinyl]-9-(oxomethylidene)-1-prop-2-enyl-7,8-dihydro-6H-benzo[7]annulen-5-one IUPAC Name: 7-[4-(2-methylphenyl)piperidin-1-yl]-9-(oxomethylidene)-1-prop-2-enyl-7,8-dihydro-6H-benzo[7]annulen-5-one Traditional Name: 1-allyl-9-(ketomethylene)-7-[4-(o-tolyl)piperidino]-7,8-dihydro-6H-benzocyclohepten-5-one Formula: C27H29NO2 MolecularWeight: 399.52466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CCN(CC2)C3CC(=C=O)C4=C(C=CC=C4CC=C)C(=O)C3

Isomeric SMILES

CC1=CC=CC=C1C2CCN(CC2)C3CC(=C=O)C4=C(C=CC=C4CC=C)C(=O)C3

InChI

InChI=1S/C27H29NO2/c1-3-7-21-9-6-11-25-26(30)17-23(16-22(18-29)27(21)25)28-14-12-20(13-15-28)24-10-5-4-8-19(24)2/h3-6,8-11,20,23H,1,7,12-17H2,2H3