azepan-1-yl-[1-(3-methoxy-4-phenylmethoxy-phenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(3-methoxy-4-phenylmethoxy-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(4-benzyloxy-3-methoxy-benzoyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[(3-methoxy-4-phenylmethoxyphenyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(3-methoxy-4-phenylmethoxybenzoyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-benzoxy-3-methoxy-benzoyl)-4-piperidyl]methanone Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H34N2O4/c1-32-25-19-23(11-12-24(25)33-20-21-9-5-4-6-10-21)27(31)29-17-13-22(14-18-29)26(30)28-15-7-2-3-8-16-28/h4-6,9-12,19,22H,2-3,7-8,13-18,20H2,1H3