ethyl 2-butyl-3-[(2-butyl-1-ethoxycarbonyl-indol-3-yl)-phenyl-methyl]indole-1-carboxylate

Systemtic Name: ethyl 2-butyl-3-[(2-butyl-1-ethoxycarbonyl-indol-3-yl)-phenyl-methyl]indole-1-carboxylate Openeye Name: ethyl 2-butyl-3-[(2-butyl-1-ethoxycarbonyl-indol-3-yl)-phenyl-methyl]indole-1-carboxylate CAS Name: 2-butyl-3-[(2-butyl-1-ethoxycarbonyl-3-indolyl)-phenylmethyl]-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-3-[(2-butyl-1-ethoxycarbonylindol-3-yl)-phenylmethyl]indole-1-carboxylate Traditional Name: 2-butyl-3-[(2-butyl-1-carbethoxy-indol-3-yl)-phenyl-methyl]indole-1-carboxylic acid ethyl ester Formula: C37H42N2O4 MolecularWeight: 578.74038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2N1C(=O)OCC)C(C3=CC=CC=C3)C4=C(N(C5=CC=CC=C54)C(=O)OCC)CCCC

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2N1C(=O)OCC)C(C3=CC=CC=C3)C4=C(N(C5=CC=CC=C54)C(=O)OCC)CCCC

InChI

InChI=1S/C37H42N2O4/c1-5-9-22-31-34(27-20-14-16-24-29(27)38(31)36(40)42-7-3)33(26-18-12-11-13-19-26)35-28-21-15-17-25-30(28)39(37(41)43-8-4)32(35)23-10-6-2/h11-21,24-25,33H,5-10,22-23H2,1-4H3