4-[(3-ethoxycarbonyl-4-naphthalen-1-yl-thiophen-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3-ethoxycarbonyl-4-naphthalen-1-yl-thiophen-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[3-ethoxycarbonyl-4-(1-naphthyl)-2-thienyl]amino]-4-oxo-butanoate CAS Name: 4-[[3-ethoxycarbonyl-4-(1-naphthalenyl)-2-thiophenyl]amino]-4-oxobutanoate IUPAC Name: 4-[(3-ethoxycarbonyl-4-naphthalen-1-ylthiophen-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[[3-carbethoxy-4-(1-naphthyl)-2-thienyl]amino]-4-keto-butyrate Formula: C21H18NO5S- MolecularWeight: 396.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC3=CC=CC=C32)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC3=CC=CC=C32)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C21H19NO5S/c1-2-27-21(26)19-16(12-28-20(19)22-17(23)10-11-18(24)25)15-9-5-7-13-6-3-4-8-14(13)15/h3-9,12H,2,10-11H2,1H3,(H,22,23)(H,24,25)/p-1