N-ethyl-1-nitro-anthracen-9-amine; N-methylmethanamine; dihydrochloride

Systemtic Name: N-ethyl-1-nitro-anthracen-9-amine; N-methylmethanamine; dihydrochloride Openeye Name: N-ethyl-1-nitro-anthracen-9-amine; N-methylmethanamine; dihydrochloride CAS Name: N-ethyl-1-nitro-9-anthracenamine; N-methylmethanamine; dihydrochloride IUPAC Name: N-ethyl-1-nitroanthracen-9-amine; N-methylmethanamine; dihydrochloride Traditional Name: dimethylamine; ethyl-(1-nitro-9-anthryl)amine; dihydrochloride Formula: C18H23Cl2N3O2 MolecularWeight: 384.30012

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=CC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].CNC.Cl.Cl

Isomeric SMILES

CCNC1=C2C(=CC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].CNC.Cl.Cl

InChI

InChI=1S/C16H14N2O2.C2H7N.2ClH/c1-2-17-16-13-8-4-3-6-11(13)10-12-7-5-9-14(15(12)16)18(19)20;1-3-2;;/h3-10,17H,2H2,1H3;3H,1-2H3;2*1H