1-(3,6-dinitrocarbazol-9-yl)-3-[(phenylmethyl)amino]propan-2-ol

Systemtic Name: 1-(3,6-dinitrocarbazol-9-yl)-3-[(phenylmethyl)amino]propan-2-ol Openeye Name: 1-(benzylamino)-3-(3,6-dinitrocarbazol-9-yl)propan-2-ol CAS Name: 1-(3,6-dinitro-9-carbazolyl)-3-[(phenylmethyl)amino]-2-propanol IUPAC Name: 1-(benzylamino)-3-(3,6-dinitrocarbazol-9-yl)propan-2-ol Traditional Name: 1-(benzylamino)-3-(3,6-dinitrocarbazol-9-yl)propan-2-ol Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC(CN2C3=C(C=C(C=C3)[N+](=O)[O-])C4=C2C=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CNCC(CN2C3=C(C=C(C=C3)[N+](=O)[O-])C4=C2C=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C22H20N4O5/c27-18(13-23-12-15-4-2-1-3-5-15)14-24-21-8-6-16(25(28)29)10-19(21)20-11-17(26(30)31)7-9-22(20)24/h1-11,18,23,27H,12-14H2