N-[(3-methoxy-4-propoxy-phenyl)-(3-methylbutanoylamino)methyl]-3-methyl-butanamide

Systemtic Name: N-[(3-methoxy-4-propoxy-phenyl)-(3-methylbutanoylamino)methyl]-3-methyl-butanamide Openeye Name: N-[(3-methoxy-4-propoxy-phenyl)-(3-methylbutanoylamino)methyl]-3-methyl-butanamide CAS Name: N-[(3-methoxy-4-propoxyphenyl)-[(3-methyl-1-oxobutyl)amino]methyl]-3-methylbutanamide IUPAC Name: N-[(3-methoxy-4-propoxyphenyl)-(3-methylbutanoylamino)methyl]-3-methylbutanamide Traditional Name: N-[(isovalerylamino)-(3-methoxy-4-propoxy-phenyl)methyl]-3-methyl-butyramide Formula: C21H34N2O4 MolecularWeight: 378.50566

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(NC(=O)CC(C)C)NC(=O)CC(C)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(NC(=O)CC(C)C)NC(=O)CC(C)C)OC

InChI

InChI=1S/C21H34N2O4/c1-7-10-27-17-9-8-16(13-18(17)26-6)21(22-19(24)11-14(2)3)23-20(25)12-15(4)5/h8-9,13-15,21H,7,10-12H2,1-6H3,(H,22,24)(H,23,25)