(E)-4-oxidanylidene-4-[(4-oxidanylidenespiro[1H-quinazoline-2,1'-cyclopentane]-3-yl)amino]but-2-enoate

Systemtic Name: (E)-4-oxidanylidene-4-[(4-oxidanylidenespiro[1H-quinazoline-2,1'-cyclopentane]-3-yl)amino]but-2-enoate Openeye Name: (E)-4-oxo-4-[(4-oxospiro[1H-quinazoline-2,1'-cyclopentane]-3-yl)amino]but-2-enoate CAS Name: (E)-4-oxo-4-[(4-oxo-3-spiro[1H-quinazoline-2,1'-cyclopentane]yl)amino]-2-butenoate IUPAC Name: (E)-4-oxo-4-[(4-oxospiro[1H-quinazoline-2,1'-cyclopentane]-3-yl)amino]but-2-enoate Traditional Name: (E)-4-keto-4-[(4-ketospiro[1H-quinazoline-2,1'-cyclopentane]-3-yl)amino]but-2-enoate Formula: C16H16N3O4- MolecularWeight: 314.31594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)NC3=CC=CC=C3C(=O)N2NC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1CCC2(C1)NC3=CC=CC=C3C(=O)N2NC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C16H17N3O4/c20-13(7-8-14(21)22)18-19-15(23)11-5-1-2-6-12(11)17-16(19)9-3-4-10-16/h1-2,5-8,17H,3-4,9-10H2,(H,18,20)(H,21,22)/p-1/b8-7+