[2-(4-morpholin-4-yl-3-nitro-phenyl)carbonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-(4-morpholin-4-yl-3-nitro-phenyl)carbonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [2-(4-morpholino-3-nitro-benzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [2-[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]-3,4-dihydro-1H-isoquinolin-3-yl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-(4-morpholin-4-yl-3-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [2-(4-morpholino-3-nitro-benzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidino-methanone Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C25H28N4O5/c30-24(19-7-8-21(22(16-19)29(32)33)26-11-13-34-14-12-26)28-17-20-6-2-1-5-18(20)15-23(28)25(31)27-9-3-4-10-27/h1-2,5-8,16,23H,3-4,9-15,17H2