4-(isocyanomethoxy)-2-(2-methylpropyl)-1-(phenylmethyl)indole

Systemtic Name: 4-(isocyanomethoxy)-2-(2-methylpropyl)-1-(phenylmethyl)indole Openeye Name: 1-benzyl-2-isobutyl-4-(isocyanomethoxy)indole CAS Name: 4-(isocyanomethoxy)-2-(2-methylpropyl)-1-(phenylmethyl)indole IUPAC Name: 1-benzyl-4-(isocyanomethoxy)-2-(2-methylpropyl)indole Traditional Name: 1-benzyl-2-isobutyl-4-(isocyanomethoxy)indole Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC2=C(N1CC3=CC=CC=C3)C=CC=C2OC[N+]#[C-]

Isomeric SMILES

CC(C)CC1=CC2=C(N1CC3=CC=CC=C3)C=CC=C2OC[N+]#[C-]

InChI

InChI=1S/C21H22N2O/c1-16(2)12-18-13-19-20(10-7-11-21(19)24-15-22-3)23(18)14-17-8-5-4-6-9-17/h4-11,13,16H,12,14-15H2,1-2H3