4-methyl-2-nitro-3-phenylmethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide

Systemtic Name: 4-methyl-2-nitro-3-phenylmethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide Openeye Name: 3-benzyloxy-4-methyl-2-nitro-N-(2-pyrrolidin-1-ylethyl)benzamide CAS Name: 4-methyl-2-nitro-3-phenylmethoxy-N-[2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 4-methyl-2-nitro-3-phenylmethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 3-benzoxy-4-methyl-2-nitro-N-(2-pyrrolidinoethyl)benzamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)NCCN2CCCC2)[N+](=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)NCCN2CCCC2)[N+](=O)[O-])OCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4/c1-16-9-10-18(21(25)22-11-14-23-12-5-6-13-23)19(24(26)27)20(16)28-15-17-7-3-2-4-8-17/h2-4,7-10H,5-6,11-15H2,1H3,(H,22,25)