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

Systemtic Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-pyrrol-1-ylphenyl)methanone Openeye Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-pyrrol-1-ylphenyl)methanone CAS Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(1-pyrrolyl)phenyl]methanone IUPAC Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-pyrrol-1-ylphenyl)methanone Traditional Name: (4-p-anisyl-1,4-diazepan-1-yl)-(4-pyrrol-1-ylphenyl)methanone Formula: C24H27N3O2 MolecularWeight: 389.49008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C24H27N3O2/c1-29-23-11-5-20(6-12-23)19-25-13-4-16-27(18-17-25)24(28)21-7-9-22(10-8-21)26-14-2-3-15-26/h2-3,5-12,14-15H,4,13,16-19H2,1H3