(3,4-dimethoxy-5-prop-2-enyl-phenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (3,4-dimethoxy-5-prop-2-enyl-phenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3-allyl-4,5-dimethoxy-phenyl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3,4-dimethoxy-5-prop-2-enylphenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3,4-dimethoxy-5-prop-2-enylphenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (3-allyl-4,5-dimethoxy-phenyl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)CC=C

InChI

InChI=1S/C25H32N2O3/c1-5-7-21-16-22(17-23(29-3)24(21)30-4)25(28)27-13-6-12-26(14-15-27)18-20-10-8-19(2)9-11-20/h5,8-11,16-17H,1,6-7,12-15,18H2,2-4H3