3-(1,2,3,4,4a,8a-hexahydronaphthalen-1-yl)-N-(1H-azepin-3-yl)-N-phenyl-propanamide

Systemtic Name: 3-(1,2,3,4,4a,8a-hexahydronaphthalen-1-yl)-N-(1H-azepin-3-yl)-N-phenyl-propanamide Openeye Name: 3-(1,2,3,4,4a,8a-hexahydronaphthalen-1-yl)-N-(1H-azepin-3-yl)-N-phenyl-propanamide CAS Name: 3-(1,2,3,4,4a,8a-hexahydronaphthalen-1-yl)-N-(1H-azepin-3-yl)-N-phenylpropanamide IUPAC Name: 3-(1,2,3,4,4a,8a-hexahydronaphthalen-1-yl)-N-(1H-azepin-3-yl)-N-phenylpropanamide Traditional Name: 3-(1,2,3,4,4a,8a-hexahydronaphthalen-1-yl)-N-(1H-azepin-3-yl)-N-phenyl-propionamide Formula: C25H28N2O MolecularWeight: 372.50262

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC=CC2C(C1)CCC(=O)N(C3=CC=CC=C3)C4=CNC=CC=C4

Isomeric SMILES

C1CC2C=CC=CC2C(C1)CCC(=O)N(C3=CC=CC=C3)C4=CNC=CC=C4

InChI

InChI=1S/C25H28N2O/c28-25(17-16-21-11-8-10-20-9-4-5-15-24(20)21)27(22-12-2-1-3-13-22)23-14-6-7-18-26-19-23/h1-7,9,12-15,18-21,24,26H,8,10-11,16-17H2