4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-3-[(E)-prop-1-enyl]benzoic acid

Systemtic Name: 4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-3-[(E)-prop-1-enyl]benzoic acid Openeye Name: 4-[2-hydroxy-3-(isopropylamino)propoxy]-3-[(E)-prop-1-enyl]benzoic acid CAS Name: 4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3-[(E)-prop-1-enyl]benzoic acid IUPAC Name: 4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3-[(E)-prop-1-enyl]benzoic acid Traditional Name: 4-[2-hydroxy-3-(isopropylamino)propoxy]-3-[(E)-prop-1-enyl]benzoic acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=C(C=CC(=C1)C(=O)O)OCC(CNC(C)C)O

Isomeric SMILES

C/C=C/C1=C(C=CC(=C1)C(=O)O)OCC(CNC(C)C)O

InChI

InChI=1S/C16H23NO4/c1-4-5-12-8-13(16(19)20)6-7-15(12)21-10-14(18)9-17-11(2)3/h4-8,11,14,17-18H,9-10H2,1-3H3,(H,19,20)/b5-4+