4-carbamimidoyl-N-methyl-N-propyl-benzamide; 2-(3,4-dihydro-2H-chromen-3-yl)ethanoate

Systemtic Name: 4-carbamimidoyl-N-methyl-N-propyl-benzamide; 2-(3,4-dihydro-2H-chromen-3-yl)ethanoate Openeye Name: 4-carbamimidoyl-N-methyl-N-propyl-benzamide; 2-chroman-3-ylacetate CAS Name: 4-carbamimidoyl-N-methyl-N-propylbenzamide; 2-(3,4-dihydro-2H-1-benzopyran-3-yl)acetate IUPAC Name: 4-carbamimidoyl-N-methyl-N-propylbenzamide; 2-(3,4-dihydro-2H-chromen-3-yl)acetate Traditional Name: 4-amidino-N-methyl-N-propyl-benzamide; 2-chroman-3-ylacetate Formula: C23H28N3O4- MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C(=O)C1=CC=C(C=C1)C(=N)N.C1C(COC2=CC=CC=C21)CC(=O)[O-]

Isomeric SMILES

CCCN(C)C(=O)C1=CC=C(C=C1)C(=N)N.C1C(COC2=CC=CC=C21)CC(=O)[O-]

InChI

InChI=1S/C12H17N3O.C11H12O3/c1-3-8-15(2)12(16)10-6-4-9(5-7-10)11(13)14;12-11(13)6-8-5-9-3-1-2-4-10(9)14-7-8/h4-7H,3,8H2,1-2H3,(H3,13,14);1-4,8H,5-7H2,(H,12,13)/p-1