N-[2-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]phenyl]benzamide

Systemtic Name: N-[2-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]phenyl]benzamide Openeye Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]phenyl]benzamide CAS Name: N-[2-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]phenyl]benzamide IUPAC Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]phenyl]benzamide Traditional Name: N-[2-(4-p-anisyl-1,4-diazepane-1-carbonyl)phenyl]benzamide Formula: C27H29N3O3 MolecularWeight: 443.53746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O3/c1-33-23-14-12-21(13-15-23)20-29-16-7-17-30(19-18-29)27(32)24-10-5-6-11-25(24)28-26(31)22-8-3-2-4-9-22/h2-6,8-15H,7,16-20H2,1H3,(H,28,31)