naphthalen-1-ylmethyl 3-(azepan-1-ylsulfonyl)-4-chloranyl-benzoate

Systemtic Name: naphthalen-1-ylmethyl 3-(azepan-1-ylsulfonyl)-4-chloranyl-benzoate Openeye Name: 1-naphthylmethyl 3-(azepan-1-ylsulfonyl)-4-chloro-benzoate CAS Name: 3-(1-azepanylsulfonyl)-4-chlorobenzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 3-(azepan-1-ylsulfonyl)-4-chlorobenzoate Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-benzoic acid 1-naphthylmethyl ester Formula: C24H24ClNO4S MolecularWeight: 457.96966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C24H24ClNO4S/c25-22-13-12-19(16-23(22)31(28,29)26-14-5-1-2-6-15-26)24(27)30-17-20-10-7-9-18-8-3-4-11-21(18)20/h3-4,7-13,16H,1-2,5-6,14-15,17H2