[2-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl] ethanoate

Systemtic Name: [2-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl] ethanoate Openeye Name: [2-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl] acetate CAS Name: acetic acid [2-[[4-(1-azepanylsulfonyl)anilino]-oxomethyl]phenyl] ester IUPAC Name: [2-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl] acetate Traditional Name: acetic acid [2-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H24N2O5S/c1-16(24)28-20-9-5-4-8-19(20)21(25)22-17-10-12-18(13-11-17)29(26,27)23-14-6-2-3-7-15-23/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,22,25)