3-(3,4,4a,8a-tetrahydronaphthalen-1-yl)-N-[1H-azepin-3-yl(phenyl)methyl]propanamide

Systemtic Name: 3-(3,4,4a,8a-tetrahydronaphthalen-1-yl)-N-[1H-azepin-3-yl(phenyl)methyl]propanamide Openeye Name: 3-(3,4,4a,8a-tetrahydronaphthalen-1-yl)-N-[1H-azepin-3-yl(phenyl)methyl]propanamide CAS Name: 3-(3,4,4a,8a-tetrahydronaphthalen-1-yl)-N-[1H-azepin-3-yl(phenyl)methyl]propanamide IUPAC Name: 3-(3,4,4a,8a-tetrahydronaphthalen-1-yl)-N-[1H-azepin-3-yl(phenyl)methyl]propanamide Traditional Name: 3-(3,4,4a,8a-tetrahydronaphthalen-1-yl)-N-[1H-azepin-3-yl(phenyl)methyl]propionamide Formula: C26H28N2O MolecularWeight: 384.51332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O/c29-25(17-16-21-14-8-13-20-9-4-5-15-24(20)21)28-26(22-10-2-1-3-11-22)23-12-6-7-18-27-19-23/h1-7,9-12,14-15,18-20,24,26-27H,8,13,16-17H2,(H,28,29)