3-(aziridin-1-yl)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]propanamide

Systemtic Name: 3-(aziridin-1-yl)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]propanamide Openeye Name: 3-(aziridin-1-yl)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]propanamide CAS Name: 3-(1-aziridinyl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]propanamide IUPAC Name: 3-(aziridin-1-yl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]propanamide Traditional Name: 3-ethylenimino-N-vanillyl-propionamide Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)CCN2CC2)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)CCN2CC2)O

InChI

InChI=1S/C13H18N2O3/c1-18-12-8-10(2-3-11(12)16)9-14-13(17)4-5-15-6-7-15/h2-3,8,16H,4-7,9H2,1H3,(H,14,17)