4-(diethylaminomethyl)-2-methyl-3-[3-[(3-morpholin-4-yl-2-nitro-phenyl)carbonylamino]phenyl]benzamide

Systemtic Name: 4-(diethylaminomethyl)-2-methyl-3-[3-[(3-morpholin-4-yl-2-nitro-phenyl)carbonylamino]phenyl]benzamide Openeye Name: 4-(diethylaminomethyl)-2-methyl-3-[3-[(3-morpholino-2-nitro-benzoyl)amino]phenyl]benzamide CAS Name: 4-(diethylaminomethyl)-2-methyl-3-[3-[[[3-(4-morpholinyl)-2-nitrophenyl]-oxomethyl]amino]phenyl]benzamide IUPAC Name: 4-(diethylaminomethyl)-2-methyl-3-[3-[(3-morpholin-4-yl-2-nitrobenzoyl)amino]phenyl]benzamide Traditional Name: 4-(diethylaminomethyl)-2-methyl-3-[3-[(3-morpholino-2-nitro-benzoyl)amino]phenyl]benzamide Formula: C30H35N5O5 MolecularWeight: 545.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=C(C=C1)C(=O)N)C)C2=CC(=CC=C2)NC(=O)C3=C(C(=CC=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CC1=C(C(=C(C=C1)C(=O)N)C)C2=CC(=CC=C2)NC(=O)C3=C(C(=CC=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C30H35N5O5/c1-4-33(5-2)19-22-12-13-24(29(31)36)20(3)27(22)21-8-6-9-23(18-21)32-30(37)25-10-7-11-26(28(25)35(38)39)34-14-16-40-17-15-34/h6-13,18H,4-5,14-17,19H2,1-3H3,(H2,31,36)(H,32,37)