benzotriazol-1-yl 3-methyl-1-(oxolan-3-yl)indole-6-carboxylate

Systemtic Name: benzotriazol-1-yl 3-methyl-1-(oxolan-3-yl)indole-6-carboxylate Openeye Name: benzotriazol-1-yl 3-methyl-1-tetrahydrofuran-3-yl-indole-6-carboxylate CAS Name: 3-methyl-1-(3-oxolanyl)-6-indolecarboxylic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 3-methyl-1-(oxolan-3-yl)indole-6-carboxylate Traditional Name: 3-methyl-1-tetrahydrofuran-3-yl-indole-6-carboxylic acid benzotriazol-1-yl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C=CC(=C2)C(=O)ON3C4=CC=CC=C4N=N3)C5CCOC5

Isomeric SMILES

CC1=CN(C2=C1C=CC(=C2)C(=O)ON3C4=CC=CC=C4N=N3)C5CCOC5

InChI

InChI=1S/C20H18N4O3/c1-13-11-23(15-8-9-26-12-15)19-10-14(6-7-16(13)19)20(25)27-24-18-5-3-2-4-17(18)21-22-24/h2-7,10-11,15H,8-9,12H2,1H3