azocan-1-yl-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone

Systemtic Name: azocan-1-yl-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone Openeye Name: azocan-1-yl-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone CAS Name: 1-azocanyl-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone IUPAC Name: azocan-1-yl-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone Traditional Name: azocan-1-yl-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H28N2O3S/c26-23(24-15-6-2-1-3-7-16-24)20-10-12-22(13-11-20)29(27,28)25-17-14-19-8-4-5-9-21(19)18-25/h4-5,8-13H,1-3,6-7,14-18H2