N-[4-[[2-(azepan-1-yl)phenyl]carbamoyl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[[2-(azepan-1-yl)phenyl]carbamoyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[[2-(azepan-1-yl)phenyl]carbamoyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[2-(1-azepanyl)anilino]-oxomethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[[2-(azepan-1-yl)phenyl]carbamoyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[[2-(azepan-1-yl)phenyl]carbamoyl]phenyl]-2-methyl-benzamide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N4CCCCCC4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N4CCCCCC4

InChI

InChI=1S/C27H29N3O2/c1-20-10-4-5-11-23(20)27(32)28-22-16-14-21(15-17-22)26(31)29-24-12-6-7-13-25(24)30-18-8-2-3-9-19-30/h4-7,10-17H,2-3,8-9,18-19H2,1H3,(H,28,32)(H,29,31)