5-[4-azanyl-3-[(4-methylphenyl)amino]phenoxy]pentanoic acid

Systemtic Name: 5-[4-azanyl-3-[(4-methylphenyl)amino]phenoxy]pentanoic acid Openeye Name: 5-[4-amino-3-(4-methylanilino)phenoxy]pentanoic acid CAS Name: 5-[4-amino-3-(4-methylanilino)phenoxy]pentanoic acid IUPAC Name: 5-[4-amino-3-(4-methylanilino)phenoxy]pentanoic acid Traditional Name: 5-[4-amino-3-(p-toluidino)phenoxy]valeric acid Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=CC(=C2)OCCCCC(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=CC(=C2)OCCCCC(=O)O)N

InChI

InChI=1S/C18H22N2O3/c1-13-5-7-14(8-6-13)20-17-12-15(9-10-16(17)19)23-11-3-2-4-18(21)22/h5-10,12,20H,2-4,11,19H2,1H3,(H,21,22)