N-[(Z)-[(3R)-3-(benzotriazol-1-yl)butylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(Z)-[(3R)-3-(benzotriazol-1-yl)butylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(Z)-[(3R)-3-(benzotriazol-1-yl)butylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(Z)-[(3R)-3-(1-benzotriazolyl)butylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(Z)-[(3R)-3-(benzotriazol-1-yl)butylidene]amino]-2,4-dinitroaniline Traditional Name: [(Z)-[(3R)-3-(benzotriazol-1-yl)butylidene]amino]-(2,4-dinitrophenyl)amine Formula: C16H15N7O4 MolecularWeight: 369.3348

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@H](C/C=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H15N7O4/c1-11(21-15-5-3-2-4-13(15)19-20-21)8-9-17-18-14-7-6-12(22(24)25)10-16(14)23(26)27/h2-7,9-11,18H,8H2,1H3/b17-9-/t11-/m1/s1