N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide

Systemtic Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide Openeye Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide CAS Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide IUPAC Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide Traditional Name: 3-(4-keto-1,2,3-benzotriazin-3-yl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]propionamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2CCNC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2CCNC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H21N5O3/c1-29-15-6-7-18-17(12-15)14(13-23-18)8-10-22-20(27)9-11-26-21(28)16-4-2-3-5-19(16)24-25-26/h2-7,12-13,23H,8-11H2,1H3,(H,22,27)