N-(4-methyl-2-morpholin-4-yl-quinolin-6-yl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-(4-methyl-2-morpholin-4-yl-quinolin-6-yl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(4-methyl-2-morpholino-6-quinolyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxo-butanamide CAS Name: N-[4-methyl-2-(4-morpholinyl)-6-quinolinyl]-4-[4-(4-nitrophenyl)-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide Traditional Name: 4-keto-N-(4-methyl-2-morpholino-6-quinolyl)-4-[4-(4-nitrophenyl)piperazino]butyramide Formula: C28H32N6O5 MolecularWeight: 532.59088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])N5CCOCC5

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])N5CCOCC5

InChI

InChI=1S/C28H32N6O5/c1-20-18-26(32-14-16-39-17-15-32)30-25-7-2-21(19-24(20)25)29-27(35)8-9-28(36)33-12-10-31(11-13-33)22-3-5-23(6-4-22)34(37)38/h2-7,18-19H,8-17H2,1H3,(H,29,35)