N-(1,3-benzodioxol-5-yl)-2-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-2-cyclohex-3-en-1-yl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-2-cyclohex-3-en-1-yl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-2-cyclohex-3-en-1-yl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(phenylmethyl)amino]-2-(1-cyclohex-3-enyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(benzotriazol-1-yl)acetyl]-benzylamino]-2-cyclohex-3-en-1-ylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-2-cyclohex-3-en-1-yl-acetamide Formula: C30H29N5O4 MolecularWeight: 523.58236

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1CC(CC=C1)C(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C30H29N5O4/c36-28(19-35-25-14-8-7-13-24(25)32-33-35)34(18-21-9-3-1-4-10-21)29(22-11-5-2-6-12-22)30(37)31-23-15-16-26-27(17-23)39-20-38-26/h1-5,7-10,13-17,22,29H,6,11-12,18-20H2,(H,31,37)