(5-azanyl-1,4-diazepan-1-yl)-[2-(3,4,5-trimethoxyphenyl)phenyl]methanone

Systemtic Name: (5-azanyl-1,4-diazepan-1-yl)-[2-(3,4,5-trimethoxyphenyl)phenyl]methanone Openeye Name: (5-amino-1,4-diazepan-1-yl)-[2-(3,4,5-trimethoxyphenyl)phenyl]methanone CAS Name: (5-amino-1,4-diazepan-1-yl)-[2-(3,4,5-trimethoxyphenyl)phenyl]methanone IUPAC Name: (5-amino-1,4-diazepan-1-yl)-[2-(3,4,5-trimethoxyphenyl)phenyl]methanone Traditional Name: (5-amino-1,4-diazepan-1-yl)-[2-(3,4,5-trimethoxyphenyl)phenyl]methanone Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC=CC=C2C(=O)N3CCC(NCC3)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC=CC=C2C(=O)N3CCC(NCC3)N

InChI

InChI=1S/C21H27N3O4/c1-26-17-12-14(13-18(27-2)20(17)28-3)15-6-4-5-7-16(15)21(25)24-10-8-19(22)23-9-11-24/h4-7,12-13,19,23H,8-11,22H2,1-3H3