3-[[4-[(2-chloranyl-4,6-dinitro-phenyl)diazenyl]naphthalen-1-yl]amino]propane-1,2-diol

Systemtic Name: 3-[[4-[(2-chloranyl-4,6-dinitro-phenyl)diazenyl]naphthalen-1-yl]amino]propane-1,2-diol Openeye Name: 3-[[4-(2-chloro-4,6-dinitro-phenyl)azo-1-naphthyl]amino]propane-1,2-diol CAS Name: 3-[[4-(2-chloro-4,6-dinitrophenyl)azo-1-naphthalenyl]amino]propane-1,2-diol IUPAC Name: 3-[[4-[(2-chloro-4,6-dinitrophenyl)diazenyl]naphthalen-1-yl]amino]propane-1,2-diol Traditional Name: 3-[[4-(2-chloro-4,6-dinitro-phenyl)azo-1-naphthyl]amino]propane-1,2-diol Formula: C19H16ClN5O6 MolecularWeight: 445.81324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])[N+](=O)[O-])NCC(CO)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])[N+](=O)[O-])NCC(CO)O

InChI

InChI=1S/C19H16ClN5O6/c20-15-7-11(24(28)29)8-18(25(30)31)19(15)23-22-17-6-5-16(21-9-12(27)10-26)13-3-1-2-4-14(13)17/h1-8,12,21,26-27H,9-10H2