2-[[2-azanylethyl-[(2-methoxy-4-oxidanylidene-1H-quinazolin-6-yl)methyl]amino]-(phenylcarbonyl)amino]pentanedioic acid

Systemtic Name: 2-[[2-azanylethyl-[(2-methoxy-4-oxidanylidene-1H-quinazolin-6-yl)methyl]amino]-(phenylcarbonyl)amino]pentanedioic acid Openeye Name: 2-[[2-aminoethyl-[(2-methoxy-4-oxo-1H-quinazolin-6-yl)methyl]amino]-benzoyl-amino]pentanedioic acid CAS Name: 2-[[2-aminoethyl-[(2-methoxy-4-oxo-1H-quinazolin-6-yl)methyl]amino]-benzoylamino]pentanedioic acid IUPAC Name: 2-[[2-aminoethyl-[(2-methoxy-4-oxo-1H-quinazolin-6-yl)methyl]amino]-benzoylamino]pentanedioic acid Traditional Name: 2-[[2-aminoethyl-[(4-keto-2-methoxy-1H-quinazolin-6-yl)methyl]amino]-benzoyl-amino]glutaric acid Formula: C24H27N5O7 MolecularWeight: 497.50048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CCN)N(C(CCC(=O)O)C(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CCN)N(C(CCC(=O)O)C(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H27N5O7/c1-36-24-26-18-8-7-15(13-17(18)21(32)27-24)14-28(12-11-25)29(19(23(34)35)9-10-20(30)31)22(33)16-5-3-2-4-6-16/h2-8,13,19H,9-12,14,25H2,1H3,(H,30,31)(H,34,35)(H,26,27,32)