N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-nitro-aniline

Systemtic Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-nitro-aniline Openeye Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-nitro-aniline CAS Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-nitroaniline IUPAC Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-nitroaniline Traditional Name: [(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-(3-nitrophenyl)amine Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCOC)C)C=NNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CCOC)C)/C=N/NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O3/c1-12-9-14(13(2)19(12)7-8-23-3)11-17-18-15-5-4-6-16(10-15)20(21)22/h4-6,9-11,18H,7-8H2,1-3H3/b17-11+