ethyl (E,4S)-4-(naphthalen-2-ylsulfonylamino)-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate

Systemtic Name: ethyl (E,4S)-4-(naphthalen-2-ylsulfonylamino)-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate Openeye Name: ethyl (E,4S)-4-(2-naphthylsulfonylamino)-5-(2-oxopyrrolidin-3-yl)pent-2-enoate CAS Name: (E,4S)-4-(2-naphthalenylsulfonylamino)-5-(2-oxo-3-pyrrolidinyl)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-(naphthalen-2-ylsulfonylamino)-5-(2-oxopyrrolidin-3-yl)pent-2-enoate Traditional Name: (E,4S)-5-(2-ketopyrrolidin-3-yl)-4-(2-naphthylsulfonylamino)pent-2-enoic acid ethyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1CCNC1=O)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)/C=C/[C@H](CC1CCNC1=O)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H24N2O5S/c1-2-28-20(24)10-8-18(13-17-11-12-22-21(17)25)23-29(26,27)19-9-7-15-5-3-4-6-16(15)14-19/h3-10,14,17-18,23H,2,11-13H2,1H3,(H,22,25)/b10-8+/t17?,18-/m1/s1