4-[(E)-2-[(6-azanyl-2,4-dimethyl-heptyl)amino]ethenyl]benzoic acid

Systemtic Name: 4-[(E)-2-[(6-azanyl-2,4-dimethyl-heptyl)amino]ethenyl]benzoic acid Openeye Name: 4-[(E)-2-[(6-amino-2,4-dimethyl-heptyl)amino]vinyl]benzoic acid CAS Name: 4-[(E)-2-[(6-amino-2,4-dimethylheptyl)amino]ethenyl]benzoic acid IUPAC Name: 4-[(E)-2-[(6-amino-2,4-dimethylheptyl)amino]ethenyl]benzoic acid Traditional Name: 4-[(E)-2-[(6-amino-2,4-dimethyl-heptyl)amino]vinyl]benzoic acid Formula: C18H28N2O2 MolecularWeight: 304.42712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(CC(C)CN/C=C/C1=CC=C(C=C1)C(=O)O)CC(C)N

InChI

InChI=1S/C18H28N2O2/c1-13(11-15(3)19)10-14(2)12-20-9-8-16-4-6-17(7-5-16)18(21)22/h4-9,13-15,20H,10-12,19H2,1-3H3,(H,21,22)/b9-8+