4-[cyclopropyl(3-oxidanylidenebutyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoate

Systemtic Name: 4-[cyclopropyl(3-oxidanylidenebutyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoate Openeye Name: 4-[cyclopropyl(3-oxobutyl)amino]-3-(2-naphthylsulfonylamino)-4-oxo-butanoate CAS Name: 4-[cyclopropyl(3-oxobutyl)amino]-3-(2-naphthalenylsulfonylamino)-4-oxobutanoate IUPAC Name: 4-[cyclopropyl(3-oxobutyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxobutanoate Traditional Name: 4-[cyclopropyl(3-ketobutyl)amino]-4-keto-3-(2-naphthylsulfonylamino)butyrate Formula: C21H23N2O6S- MolecularWeight: 431.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN(C1CC1)C(=O)C(CC(=O)[O-])NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(=O)CCN(C1CC1)C(=O)C(CC(=O)[O-])NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H24N2O6S/c1-14(24)10-11-23(17-7-8-17)21(27)19(13-20(25)26)22-30(28,29)18-9-6-15-4-2-3-5-16(15)12-18/h2-6,9,12,17,19,22H,7-8,10-11,13H2,1H3,(H,25,26)/p-1