dipropan-2-yl 3-(1-hydroxyethyl)-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate

Systemtic Name: dipropan-2-yl 3-(1-hydroxyethyl)-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate Openeye Name: diisopropyl 3-(1-hydroxyethyl)-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate CAS Name: 3-(1-hydroxyethyl)-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 3-(1-hydroxyethyl)-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate Traditional Name: 3-(1-hydroxyethyl)-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylic acid diisopropyl ester Formula: C23H30N2O7 MolecularWeight: 446.4935

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1(CC(C(C2=C1NC3=CC=CC=C32)C[N+](=O)[O-])C(C)O)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)C1(CC(C(C2=C1NC3=CC=CC=C32)C[N+](=O)[O-])C(C)O)C(=O)OC(C)C

InChI

InChI=1S/C23H30N2O7/c1-12(2)31-21(27)23(22(28)32-13(3)4)10-16(14(5)26)17(11-25(29)30)19-15-8-6-7-9-18(15)24-20(19)23/h6-9,12-14,16-17,24,26H,10-11H2,1-5H3