[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-methyl-3-pyrrol-1-yl-phenyl)methanone

Systemtic Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-methyl-3-pyrrol-1-yl-phenyl)methanone Openeye Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-methyl-3-pyrrol-1-yl-phenyl)methanone CAS Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-methyl-3-(1-pyrrolyl)phenyl]methanone IUPAC Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-methyl-3-pyrrol-1-ylphenyl)methanone Traditional Name: (4-methyl-3-pyrrol-1-yl-phenyl)-(4-p-anisyl-1,4-diazepan-1-yl)methanone Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC)N4C=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-20-6-9-22(18-24(20)27-13-3-4-14-27)25(29)28-15-5-12-26(16-17-28)19-21-7-10-23(30-2)11-8-21/h3-4,6-11,13-14,18H,5,12,15-17,19H2,1-2H3