8-[2-(azepan-1-yl)ethoxy]-3-(phenylsulfonyl)quinoline

Systemtic Name: 8-[2-(azepan-1-yl)ethoxy]-3-(phenylsulfonyl)quinoline Openeye Name: 8-[2-(azepan-1-yl)ethoxy]-3-(benzenesulfonyl)quinoline CAS Name: 8-[2-(1-azepanyl)ethoxy]-3-(benzenesulfonyl)quinoline IUPAC Name: 8-[2-(azepan-1-yl)ethoxy]-3-(benzenesulfonyl)quinoline Traditional Name: 8-[2-(azepan-1-yl)ethoxy]-3-besyl-quinoline Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CCOC2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H26N2O3S/c26-29(27,20-10-4-3-5-11-20)21-17-19-9-8-12-22(23(19)24-18-21)28-16-15-25-13-6-1-2-7-14-25/h3-5,8-12,17-18H,1-2,6-7,13-16H2