6-(azepan-1-yl)-4,4-diphenyl-heptan-3-one

Systemtic Name: 6-(azepan-1-yl)-4,4-diphenyl-heptan-3-one Openeye Name: 6-(azepan-1-yl)-4,4-diphenyl-heptan-3-one CAS Name: 6-(1-azepanyl)-4,4-diphenyl-3-heptanone IUPAC Name: 6-(azepan-1-yl)-4,4-diphenylheptan-3-one Traditional Name: 6-(azepan-1-yl)-4,4-diphenyl-heptan-3-one Formula: C25H33NO MolecularWeight: 363.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC(C)N1CCCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)C(CC(C)N1CCCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H33NO/c1-3-24(27)25(22-14-8-6-9-15-22,23-16-10-7-11-17-23)20-21(2)26-18-12-4-5-13-19-26/h6-11,14-17,21H,3-5,12-13,18-20H2,1-2H3