[4-(1,2,3,4-tetrazol-1-yl)phenyl] 3-(1H-indol-3-yl)propanoate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 3-(1H-indol-3-yl)propanoate Openeye Name: [4-(tetrazol-1-yl)phenyl] 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C18H15N5O2 MolecularWeight: 333.344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCC(=O)OC3=CC=C(C=C3)N4C=NN=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCC(=O)OC3=CC=C(C=C3)N4C=NN=N4

InChI

InChI=1S/C18H15N5O2/c24-18(10-5-13-11-19-17-4-2-1-3-16(13)17)25-15-8-6-14(7-9-15)23-12-20-21-22-23/h1-4,6-9,11-12,19H,5,10H2