methyl 4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]-1,3-bis(oxidanylidene)-2-propyl-isoquinoline-4-carboxylate

Systemtic Name: methyl 4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]-1,3-bis(oxidanylidene)-2-propyl-isoquinoline-4-carboxylate Openeye Name: methyl 4-[2-(methoxycarbonylamino)-2-oxo-ethyl]-1,3-dioxo-2-propyl-isoquinoline-4-carboxylate CAS Name: 4-[2-(methoxycarbonylamino)-2-oxoethyl]-1,3-dioxo-2-propyl-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(methoxycarbonylamino)-2-oxoethyl]-1,3-dioxo-2-propylisoquinoline-4-carboxylate Traditional Name: 4-[2-(carbomethoxyamino)-2-keto-ethyl]-1,3-diketo-2-propyl-isoquinoline-4-carboxylic acid methyl ester Formula: C18H20N2O7 MolecularWeight: 376.3606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

InChI

InChI=1S/C18H20N2O7/c1-4-9-20-14(22)11-7-5-6-8-12(11)18(15(20)23,16(24)26-2)10-13(21)19-17(25)27-3/h5-8H,4,9-10H2,1-3H3,(H,19,21,25)