N-[3-(azepan-1-yl)propyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide CAS Name: N-[3-(1-azepanyl)propyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Formula: C26H35N3O MolecularWeight: 405.5756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C26H35N3O/c30-26(27-15-7-18-28-16-5-1-2-6-17-28)24-12-10-22(11-13-24)20-29-19-14-23-8-3-4-9-25(23)21-29/h3-4,8-13H,1-2,5-7,14-21H2,(H,27,30)