N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-3-(phenylcarbamoylamino)propanamide

Systemtic Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-3-(phenylcarbamoylamino)propanamide Openeye Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-3-(phenylcarbamoylamino)propanamide CAS Name: 3-[[anilino(oxo)methyl]amino]-N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]propanamide IUPAC Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-3-(phenylcarbamoylamino)propanamide Traditional Name: N-[(5-ethoxy-2-methyl-coumaran-6-yl)methyl]-3-(phenylcarbamoylamino)propionamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4/c1-3-28-19-12-16-11-15(2)29-20(16)13-17(19)14-24-21(26)9-10-23-22(27)25-18-7-5-4-6-8-18/h4-8,12-13,15H,3,9-11,14H2,1-2H3,(H,24,26)(H2,23,25,27)