[3-(butylamino)-2-oxidanyl-propyl] 4-(butoxycarbonylamino)benzoate

Systemtic Name: [3-(butylamino)-2-oxidanyl-propyl] 4-(butoxycarbonylamino)benzoate Openeye Name: [3-(butylamino)-2-hydroxy-propyl] 4-(butoxycarbonylamino)benzoate CAS Name: 4-[[butoxy(oxo)methyl]amino]benzoic acid [3-(butylamino)-2-hydroxypropyl] ester IUPAC Name: [3-(butylamino)-2-hydroxypropyl] 4-(butoxycarbonylamino)benzoate Traditional Name: 4-(butoxycarbonylamino)benzoic acid [3-(butylamino)-2-hydroxy-propyl] ester Formula: C19H30N2O5 MolecularWeight: 366.4519

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(COC(=O)C1=CC=C(C=C1)NC(=O)OCCCC)O

Isomeric SMILES

CCCCNCC(COC(=O)C1=CC=C(C=C1)NC(=O)OCCCC)O

InChI

InChI=1S/C19H30N2O5/c1-3-5-11-20-13-17(22)14-26-18(23)15-7-9-16(10-8-15)21-19(24)25-12-6-4-2/h7-10,17,20,22H,3-6,11-14H2,1-2H3,(H,21,24)