4-[(E)-[10-(3-azanylpropyl)-3,4-dimethyl-acridin-9-ylidene]amino]oxybutanoic acid

Systemtic Name: 4-[(E)-[10-(3-azanylpropyl)-3,4-dimethyl-acridin-9-ylidene]amino]oxybutanoic acid Openeye Name: 4-[(E)-[10-(3-aminopropyl)-3,4-dimethyl-acridin-9-ylidene]amino]oxybutanoic acid CAS Name: 4-[(E)-[10-(3-aminopropyl)-3,4-dimethyl-9-acridinylidene]amino]oxybutanoic acid IUPAC Name: 4-[(E)-[10-(3-aminopropyl)-3,4-dimethylacridin-9-ylidene]amino]oxybutanoic acid Traditional Name: 4-[(E)-[10-(3-aminopropyl)-3,4-dimethyl-acridin-9-ylidene]amino]oxybutyric acid Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=NOCCCC(=O)O)C3=CC=CC=C3N2CCCN)C

Isomeric SMILES

CC1=C(C2=C(C=C1)/C(=N/OCCCC(=O)O)/C3=CC=CC=C3N2CCCN)C

InChI

InChI=1S/C22H27N3O3/c1-15-10-11-18-21(24-28-14-5-9-20(26)27)17-7-3-4-8-19(17)25(13-6-12-23)22(18)16(15)2/h3-4,7-8,10-11H,5-6,9,12-14,23H2,1-2H3,(H,26,27)/b24-21+