[9-[[2,6-bis(chloranyl)phenyl]methyl]-5-chloranyl-6-methyl-8-nitro-1,2,3,4-tetrahydrocarbazol-3-yl] 4-pentoxybenzoate

Systemtic Name: [9-[[2,6-bis(chloranyl)phenyl]methyl]-5-chloranyl-6-methyl-8-nitro-1,2,3,4-tetrahydrocarbazol-3-yl] 4-pentoxybenzoate Openeye Name: [5-chloro-9-[(2,6-dichlorophenyl)methyl]-6-methyl-8-nitro-1,2,3,4-tetrahydrocarbazol-3-yl] 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid [5-chloro-9-[(2,6-dichlorophenyl)methyl]-6-methyl-8-nitro-1,2,3,4-tetrahydrocarbazol-3-yl] ester IUPAC Name: [5-chloro-9-[(2,6-dichlorophenyl)methyl]-6-methyl-8-nitro-1,2,3,4-tetrahydrocarbazol-3-yl] 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid [5-chloro-9-(2,6-dichlorobenzyl)-6-methyl-8-nitro-1,2,3,4-tetrahydrocarbazol-3-yl] ester Formula: C32H31Cl3N2O5 MolecularWeight: 629.95794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC2CCC3=C(C2)C4=C(C(=CC(=C4N3CC5=C(C=CC=C5Cl)Cl)[N+](=O)[O-])C)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC2CCC3=C(C2)C4=C(C(=CC(=C4N3CC5=C(C=CC=C5Cl)Cl)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C32H31Cl3N2O5/c1-3-4-5-15-41-21-11-9-20(10-12-21)32(38)42-22-13-14-27-23(17-22)29-30(35)19(2)16-28(37(39)40)31(29)36(27)18-24-25(33)7-6-8-26(24)34/h6-12,16,22H,3-5,13-15,17-18H2,1-2H3