N-[(Z)-1-[4-ethoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]-2-nitro-aniline

Systemtic Name: N-[(Z)-1-[4-ethoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]-2-nitro-aniline Openeye Name: N-[(Z)-1-[4-ethoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]-2-nitro-aniline CAS Name: N-[(Z)-1-[4-ethoxy-3-(4-morpholin-4-iumylmethyl)phenyl]ethylideneamino]-2-nitroaniline IUPAC Name: N-[(Z)-1-[4-ethoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]-2-nitroaniline Traditional Name: [(Z)-1-[4-ethoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]-(2-nitrophenyl)amine Formula: C21H27N4O4+ MolecularWeight: 399.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=NNC2=CC=CC=C2[N+](=O)[O-])C)C[NH+]3CCOCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C(=N\NC2=CC=CC=C2[N+](=O)[O-])/C)C[NH+]3CCOCC3

InChI

InChI=1S/C21H26N4O4/c1-3-29-21-9-8-17(14-18(21)15-24-10-12-28-13-11-24)16(2)22-23-19-6-4-5-7-20(19)25(26)27/h4-9,14,23H,3,10-13,15H2,1-2H3/p+1/b22-16-