(4-methyl-3-nitro-phenyl)methyl 5-(2-diethylaminoethyl)-2-methyl-1H-indole-3-carboxylate

Systemtic Name: (4-methyl-3-nitro-phenyl)methyl 5-(2-diethylaminoethyl)-2-methyl-1H-indole-3-carboxylate Openeye Name: (4-methyl-3-nitro-phenyl)methyl 5-(2-diethylaminoethyl)-2-methyl-1H-indole-3-carboxylate CAS Name: 5-(2-diethylaminoethyl)-2-methyl-1H-indole-3-carboxylic acid (4-methyl-3-nitrophenyl)methyl ester IUPAC Name: (4-methyl-3-nitrophenyl)methyl 5-(2-diethylaminoethyl)-2-methyl-1H-indole-3-carboxylate Traditional Name: 5-(2-diethylaminoethyl)-2-methyl-1H-indole-3-carboxylic acid (4-methyl-3-nitro-benzyl) ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=CC2=C(C=C1)NC(=C2C(=O)OCC3=CC(=C(C=C3)C)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)CCC1=CC2=C(C=C1)NC(=C2C(=O)OCC3=CC(=C(C=C3)C)[N+](=O)[O-])C

InChI

InChI=1S/C24H29N3O4/c1-5-26(6-2)12-11-18-9-10-21-20(13-18)23(17(4)25-21)24(28)31-15-19-8-7-16(3)22(14-19)27(29)30/h7-10,13-14,25H,5-6,11-12,15H2,1-4H3