4-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzoic acid

Systemtic Name: 4-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzoic acid Openeye Name: 4-[[5-(2-methylcyclopropyl)-2-furyl]methylamino]benzoic acid CAS Name: 4-[[5-(2-methylcyclopropyl)-2-furanyl]methylamino]benzoic acid IUPAC Name: 4-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzoic acid Traditional Name: 4-[[5-(2-methylcyclopropyl)-2-furyl]methylamino]benzoic acid Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=CC=C(O2)CNC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1CC1C2=CC=C(O2)CNC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H17NO3/c1-10-8-14(10)15-7-6-13(20-15)9-17-12-4-2-11(3-5-12)16(18)19/h2-7,10,14,17H,8-9H2,1H3,(H,18,19)