1-[6-methoxy-6-(5-methyl-2-nitro-phenoxy)cyclohexa-2,4-dien-1-yl]-N-methyl-methanamine

Systemtic Name: 1-[6-methoxy-6-(5-methyl-2-nitro-phenoxy)cyclohexa-2,4-dien-1-yl]-N-methyl-methanamine Openeye Name: 1-[6-methoxy-6-(5-methyl-2-nitro-phenoxy)cyclohexa-2,4-dien-1-yl]-N-methyl-methanamine CAS Name: 1-[6-methoxy-6-(5-methyl-2-nitrophenoxy)-1-cyclohexa-2,4-dienyl]-N-methylmethanamine IUPAC Name: 1-[6-methoxy-6-(5-methyl-2-nitrophenoxy)cyclohexa-2,4-dien-1-yl]-N-methylmethanamine Traditional Name: [6-methoxy-6-(5-methyl-2-nitro-phenoxy)cyclohexa-2,4-dien-1-yl]methyl-methyl-amine Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OC2(C=CC=CC2CNC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OC2(C=CC=CC2CNC)OC

InChI

InChI=1S/C16H20N2O4/c1-12-7-8-14(18(19)20)15(10-12)22-16(21-3)9-5-4-6-13(16)11-17-2/h4-10,13,17H,11H2,1-3H3