ethyl 1,2-dimethyl-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methoxy]indole-3-carboxylate

Systemtic Name: ethyl 1,2-dimethyl-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methoxy]indole-3-carboxylate Openeye Name: ethyl 1,2-dimethyl-5-[(1-phenyltetrazol-5-yl)methoxy]indole-3-carboxylate CAS Name: 1,2-dimethyl-5-[(1-phenyl-5-tetrazolyl)methoxy]-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,2-dimethyl-5-[(1-phenyltetrazol-5-yl)methoxy]indole-3-carboxylate Traditional Name: 1,2-dimethyl-5-[(1-phenyltetrazol-5-yl)methoxy]indole-3-carboxylic acid ethyl ester Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC3=NN=NN3C4=CC=CC=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC3=NN=NN3C4=CC=CC=C4)C)C

InChI

InChI=1S/C21H21N5O3/c1-4-28-21(27)20-14(2)25(3)18-11-10-16(12-17(18)20)29-13-19-22-23-24-26(19)15-8-6-5-7-9-15/h5-12H,4,13H2,1-3H3