4-(benzotriazol-1-ylmethyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(4-methoxyphenyl)-2-morpholino-ethyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[2-(4-methoxyphenyl)-2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(4-methoxyphenyl)-2-morpholino-ethyl]benzamide Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)N5CCOCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)N5CCOCC5

InChI

InChI=1S/C27H29N5O3/c1-34-23-12-10-21(11-13-23)26(31-14-16-35-17-15-31)18-28-27(33)22-8-6-20(7-9-22)19-32-25-5-3-2-4-24(25)29-30-32/h2-13,26H,14-19H2,1H3,(H,28,33)