(6-methoxy-2-methyl-quinolin-3-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (6-methoxy-2-methyl-quinolin-3-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (6-methoxy-2-methyl-3-quinolyl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (6-methoxy-2-methyl-3-quinolinyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (6-methoxy-2-methylquinolin-3-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (6-methoxy-2-methyl-3-quinolyl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=C(N=C4C=CC(=CC4=C3)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=C(N=C4C=CC(=CC4=C3)OC)C

InChI

InChI=1S/C25H29N3O2/c1-18-5-7-20(8-6-18)17-27-11-4-12-28(14-13-27)25(29)23-16-21-15-22(30-3)9-10-24(21)26-19(23)2/h5-10,15-16H,4,11-14,17H2,1-3H3