[4-(4-cyanophenyl)-1-(phenylmethyl)indol-5-yl] N,N-diethylcarbamate

Systemtic Name: [4-(4-cyanophenyl)-1-(phenylmethyl)indol-5-yl] N,N-diethylcarbamate Openeye Name: [1-benzyl-4-(4-cyanophenyl)indol-5-yl] N,N-diethylcarbamate CAS Name: N,N-diethylcarbamic acid [4-(4-cyanophenyl)-1-(phenylmethyl)-5-indolyl] ester IUPAC Name: [1-benzyl-4-(4-cyanophenyl)indol-5-yl] N,N-diethylcarbamate Traditional Name: N,N-diethylcarbamic acid [1-benzyl-4-(4-cyanophenyl)indol-5-yl] ester Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)OC1=C(C2=C(C=C1)N(C=C2)CC3=CC=CC=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCN(CC)C(=O)OC1=C(C2=C(C=C1)N(C=C2)CC3=CC=CC=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H25N3O2/c1-3-29(4-2)27(31)32-25-15-14-24-23(26(25)22-12-10-20(18-28)11-13-22)16-17-30(24)19-21-8-6-5-7-9-21/h5-17H,3-4,19H2,1-2H3