1-[1-methyl-4-nitro-5-[(phenylmethyl)amino]pyrrol-2-yl]ethanone

Systemtic Name: 1-[1-methyl-4-nitro-5-[(phenylmethyl)amino]pyrrol-2-yl]ethanone Openeye Name: 1-[5-(benzylamino)-1-methyl-4-nitro-pyrrol-2-yl]ethanone CAS Name: 1-[1-methyl-4-nitro-5-[(phenylmethyl)amino]-2-pyrrolyl]ethanone IUPAC Name: 1-[5-(benzylamino)-1-methyl-4-nitropyrrol-2-yl]ethanone Traditional Name: 1-[5-(benzylamino)-1-methyl-4-nitro-pyrrol-2-yl]ethanone Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(N1C)NCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(N1C)NCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O3/c1-10(18)12-8-13(17(19)20)14(16(12)2)15-9-11-6-4-3-5-7-11/h3-8,15H,9H2,1-2H3