ethyl 3-[(4-tert-butylphenyl)carbamoylamino]-1-methyl-5-nitro-indole-2-carboxylate

Systemtic Name: ethyl 3-[(4-tert-butylphenyl)carbamoylamino]-1-methyl-5-nitro-indole-2-carboxylate Openeye Name: ethyl 3-[(4-tert-butylphenyl)carbamoylamino]-1-methyl-5-nitro-indole-2-carboxylate CAS Name: 3-[[(4-tert-butylanilino)-oxomethyl]amino]-1-methyl-5-nitro-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-tert-butylphenyl)carbamoylamino]-1-methyl-5-nitroindole-2-carboxylate Traditional Name: 3-[(4-tert-butylphenyl)carbamoylamino]-1-methyl-5-nitro-indole-2-carboxylic acid ethyl ester Formula: C23H26N4O5 MolecularWeight: 438.47634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)[N+](=O)[O-])NC(=O)NC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)[N+](=O)[O-])NC(=O)NC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H26N4O5/c1-6-32-21(28)20-19(17-13-16(27(30)31)11-12-18(17)26(20)5)25-22(29)24-15-9-7-14(8-10-15)23(2,3)4/h7-13H,6H2,1-5H3,(H2,24,25,29)