N-[3-[[4-(diethylaminomethyl)phenyl]carbonylamino]-4-methyl-phenyl]-5-morpholin-4-yl-2-nitro-benzamide

Systemtic Name: N-[3-[[4-(diethylaminomethyl)phenyl]carbonylamino]-4-methyl-phenyl]-5-morpholin-4-yl-2-nitro-benzamide Openeye Name: N-[3-[[4-(diethylaminomethyl)benzoyl]amino]-4-methyl-phenyl]-5-morpholino-2-nitro-benzamide CAS Name: N-[3-[[[4-(diethylaminomethyl)phenyl]-oxomethyl]amino]-4-methylphenyl]-5-(4-morpholinyl)-2-nitrobenzamide IUPAC Name: N-[3-[[4-(diethylaminomethyl)benzoyl]amino]-4-methylphenyl]-5-morpholin-4-yl-2-nitrobenzamide Traditional Name: N-[3-[[4-(diethylaminomethyl)benzoyl]amino]-4-methyl-phenyl]-5-morpholino-2-nitro-benzamide Formula: C30H35N5O5 MolecularWeight: 545.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)C3=C(C=CC(=C3)N4CCOCC4)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)C3=C(C=CC(=C3)N4CCOCC4)[N+](=O)[O-])C

InChI

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