1-(azepan-1-yl)-4-[(4-naphthalen-1-yloxy-3-oxidanyl-butyl)amino]-2-phenyl-butan-1-one

Systemtic Name: 1-(azepan-1-yl)-4-[(4-naphthalen-1-yloxy-3-oxidanyl-butyl)amino]-2-phenyl-butan-1-one Openeye Name: 1-(azepan-1-yl)-4-[[3-hydroxy-4-(1-naphthyloxy)butyl]amino]-2-phenyl-butan-1-one CAS Name: 1-(1-azepanyl)-4-[[3-hydroxy-4-(1-naphthalenyloxy)butyl]amino]-2-phenyl-1-butanone IUPAC Name: 1-(azepan-1-yl)-4-[(3-hydroxy-4-naphthalen-1-yloxybutyl)amino]-2-phenylbutan-1-one Traditional Name: 1-(azepan-1-yl)-4-[[3-hydroxy-4-(1-naphthoxy)butyl]amino]-2-phenyl-butan-1-one Formula: C30H38N2O3 MolecularWeight: 474.63432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(CCNCCC(COC2=CC=CC3=CC=CC=C32)O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C(CCNCCC(COC2=CC=CC3=CC=CC=C32)O)C4=CC=CC=C4

InChI

InChI=1S/C30H38N2O3/c33-26(23-35-29-16-10-14-24-13-6-7-15-27(24)29)17-19-31-20-18-28(25-11-4-3-5-12-25)30(34)32-21-8-1-2-9-22-32/h3-7,10-16,26,28,31,33H,1-2,8-9,17-23H2