N-[2,6-di(propan-2-yl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(2,6-diisopropylphenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(2,6-diisopropylphenyl)-3-nitro-4-pyrrolidino-benzamide Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O3/c1-15(2)18-8-7-9-19(16(3)4)22(18)24-23(27)17-10-11-20(21(14-17)26(28)29)25-12-5-6-13-25/h7-11,14-16H,5-6,12-13H2,1-4H3,(H,24,27)