N-[4-[3-(benzotriazol-1-yl)propanoylamino]-2,5-diethoxy-phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[3-(benzotriazol-1-yl)propanoylamino]-2,5-diethoxy-phenyl]-3-methyl-butanamide Openeye Name: N-[4-[3-(benzotriazol-1-yl)propanoylamino]-2,5-diethoxy-phenyl]-3-methyl-butanamide CAS Name: N-[4-[[3-(1-benzotriazolyl)-1-oxopropyl]amino]-2,5-diethoxyphenyl]-3-methylbutanamide IUPAC Name: N-[4-[3-(benzotriazol-1-yl)propanoylamino]-2,5-diethoxyphenyl]-3-methylbutanamide Traditional Name: N-[4-[3-(benzotriazol-1-yl)propanoylamino]-2,5-diethoxy-phenyl]-3-methyl-butyramide Formula: C24H31N5O4 MolecularWeight: 453.53404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)CCN2C3=CC=CC=C3N=N2)OCC)NC(=O)CC(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)CCN2C3=CC=CC=C3N=N2)OCC)NC(=O)CC(C)C

InChI

InChI=1S/C24H31N5O4/c1-5-32-21-15-19(26-24(31)13-16(3)4)22(33-6-2)14-18(21)25-23(30)11-12-29-20-10-8-7-9-17(20)27-28-29/h7-10,14-16H,5-6,11-13H2,1-4H3,(H,25,30)(H,26,31)