N-[[2-[2-azanyl-3,4-bis(oxidanylidene)cyclobuten-1-yl]-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[[2-[2-azanyl-3,4-bis(oxidanylidene)cyclobuten-1-yl]-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[[2-(2-amino-3,4-dioxo-cyclobuten-1-yl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[[2-(2-amino-3,4-dioxo-1-cyclobutenyl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[[2-(2-amino-3,4-dioxocyclobuten-1-yl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[[2-(2-amino-3,4-diketo-cyclobuten-1-yl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-1-methyl-pyrrole-2-carboxamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NCC2=CC3=C(CCN(C3)C4=C(C(=O)C4=O)N)C=C2

Isomeric SMILES

CN1C=CC=C1C(=O)NCC2=CC3=C(CCN(C3)C4=C(C(=O)C4=O)N)C=C2

InChI

InChI=1S/C20H20N4O3/c1-23-7-2-3-15(23)20(27)22-10-12-4-5-13-6-8-24(11-14(13)9-12)17-16(21)18(25)19(17)26/h2-5,7,9H,6,8,10-11,21H2,1H3,(H,22,27)