1-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]-3-methyl-benzimidazol-2-one

Systemtic Name: 1-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]-3-methyl-benzimidazol-2-one Openeye Name: 1-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxo-propyl]-3-methyl-benzimidazol-2-one CAS Name: 1-[3-[2-(4-methoxyphenyl)-1-azepanyl]-3-oxopropyl]-3-methyl-2-benzimidazolone IUPAC Name: 1-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxopropyl]-3-methylbenzimidazol-2-one Traditional Name: 1-[3-keto-3-[2-(4-methoxyphenyl)azepan-1-yl]propyl]-3-methyl-benzimidazol-2-one Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCCCCC3C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCCCCC3C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H29N3O3/c1-25-21-9-5-6-10-22(21)27(24(25)29)17-15-23(28)26-16-7-3-4-8-20(26)18-11-13-19(30-2)14-12-18/h5-6,9-14,20H,3-4,7-8,15-17H2,1-2H3