4-[(2,3-dihydro-1H-inden-5-ylcarbamoylamino)methyl]benzoate

Systemtic Name: 4-[(2,3-dihydro-1H-inden-5-ylcarbamoylamino)methyl]benzoate Openeye Name: 4-[(indan-5-ylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[(2,3-dihydro-1H-inden-5-ylamino)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[(2,3-dihydro-1H-inden-5-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(indan-5-ylcarbamoylamino)methyl]benzoate Formula: C18H17N2O3- MolecularWeight: 309.33918

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C18H18N2O3/c21-17(22)14-6-4-12(5-7-14)11-19-18(23)20-16-9-8-13-2-1-3-15(13)10-16/h4-10H,1-3,11H2,(H,21,22)(H2,19,20,23)/p-1