4-[3-azanyl-2-methoxy-5-(phenylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[3-azanyl-2-methoxy-5-(phenylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-(3-amino-5-benzyl-2-methoxy-phenyl)-2,4-dioxo-butanoic acid CAS Name: 4-[3-amino-2-methoxy-5-(phenylmethyl)phenyl]-2,4-dioxobutanoic acid IUPAC Name: 4-(3-amino-5-benzyl-2-methoxyphenyl)-2,4-dioxobutanoic acid Traditional Name: 4-(3-amino-5-benzyl-2-methoxy-phenyl)-2,4-diketo-butyric acid Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)CC(=O)C(=O)O)CC2=CC=CC=C2)N

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)CC(=O)C(=O)O)CC2=CC=CC=C2)N

InChI

InChI=1S/C18H17NO5/c1-24-17-13(15(20)10-16(21)18(22)23)8-12(9-14(17)19)7-11-5-3-2-4-6-11/h2-6,8-9H,7,10,19H2,1H3,(H,22,23)