[1-[3-(azepan-1-yl)propyl]-4-oxidanyl-4-phenyl-piperidin-3-yl]-phenyl-methanone

Systemtic Name: [1-[3-(azepan-1-yl)propyl]-4-oxidanyl-4-phenyl-piperidin-3-yl]-phenyl-methanone Openeye Name: [1-[3-(azepan-1-yl)propyl]-4-hydroxy-4-phenyl-3-piperidyl]-phenyl-methanone CAS Name: [1-[3-(1-azepanyl)propyl]-4-hydroxy-4-phenyl-3-piperidinyl]-phenylmethanone IUPAC Name: [1-[3-(azepan-1-yl)propyl]-4-hydroxy-4-phenylpiperidin-3-yl]-phenylmethanone Traditional Name: [1-[3-(azepan-1-yl)propyl]-4-hydroxy-4-phenyl-3-piperidyl]-phenyl-methanone Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCN2CCC(C(C2)C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

C1CCCN(CC1)CCCN2CCC(C(C2)C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C27H36N2O2/c30-26(23-12-5-3-6-13-23)25-22-29(20-11-19-28-17-9-1-2-10-18-28)21-16-27(25,31)24-14-7-4-8-15-24/h3-8,12-15,25,31H,1-2,9-11,16-22H2