N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]-3-nitro-aniline

Systemtic Name: N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]-3-nitro-aniline Openeye Name: N-[(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]-3-nitro-aniline CAS Name: N-[(Z)-[(1S)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-ylidene]amino]-3-nitroaniline IUPAC Name: N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-ylidene]amino]-3-nitroaniline Traditional Name: [(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]-(3-nitrophenyl)amine Formula: C19H23N4O3+ MolecularWeight: 355.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=CC(=CC=C1)[N+](=O)[O-])C(C2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

C/C(=N/NC1=CC(=CC=C1)[N+](=O)[O-])/[C@H](C2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C19H22N4O3/c1-15(20-21-17-8-5-9-18(14-17)23(24)25)19(16-6-3-2-4-7-16)22-10-12-26-13-11-22/h2-9,14,19,21H,10-13H2,1H3/p+1/b20-15-/t19-/m1/s1