N-[1-(3-acetamidophenyl)ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-3-nitro-4-pyrrolidino-benzamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O4/c1-14(16-6-5-7-18(12-16)23-15(2)26)22-21(27)17-8-9-19(20(13-17)25(28)29)24-10-3-4-11-24/h5-9,12-14H,3-4,10-11H2,1-2H3,(H,22,27)(H,23,26)