N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[1-(4-isobutylphenyl)ethyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[1-(4-isobutylphenyl)ethyl]-4-morpholino-3-nitro-benzamide Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O4/c1-16(2)14-18-4-6-19(7-5-18)17(3)24-23(27)20-8-9-21(22(15-20)26(28)29)25-10-12-30-13-11-25/h4-9,15-17H,10-14H2,1-3H3,(H,24,27)