4-tert-butyl-3-[[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]carbamoylamino]benzoic acid

Systemtic Name: 4-tert-butyl-3-[[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]carbamoylamino]benzoic acid Openeye Name: 4-tert-butyl-3-[[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]carbamoylamino]benzoic acid CAS Name: 4-tert-butyl-3-[[[[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]amino]-oxomethyl]amino]benzoic acid IUPAC Name: 4-tert-butyl-3-[[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]carbamoylamino]benzoic acid Traditional Name: 4-tert-butyl-3-[[1-butyl-2-keto-4-(3-methoxyphenyl)-1,8-naphthyridin-3-yl]carbamoylamino]benzoic acid Formula: C31H34N4O5 MolecularWeight: 542.62546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC=N2)C(=C(C1=O)NC(=O)NC3=C(C=CC(=C3)C(=O)O)C(C)(C)C)C4=CC(=CC=C4)OC

Isomeric SMILES

CCCCN1C2=C(C=CC=N2)C(=C(C1=O)NC(=O)NC3=C(C=CC(=C3)C(=O)O)C(C)(C)C)C4=CC(=CC=C4)OC

InChI

InChI=1S/C31H34N4O5/c1-6-7-16-35-27-22(12-9-15-32-27)25(19-10-8-11-21(17-19)40-5)26(28(35)36)34-30(39)33-24-18-20(29(37)38)13-14-23(24)31(2,3)4/h8-15,17-18H,6-7,16H2,1-5H3,(H,37,38)(H2,33,34,39)