3-[[6-(4-phenylbutoxy)-3,4-dihydronaphthalen-2-yl]methylamino]butanoic acid

Systemtic Name: 3-[[6-(4-phenylbutoxy)-3,4-dihydronaphthalen-2-yl]methylamino]butanoic acid Openeye Name: 3-[[6-(4-phenylbutoxy)-3,4-dihydronaphthalen-2-yl]methylamino]butanoic acid CAS Name: 3-[[6-(4-phenylbutoxy)-3,4-dihydronaphthalen-2-yl]methylamino]butanoic acid IUPAC Name: 3-[[6-(4-phenylbutoxy)-3,4-dihydronaphthalen-2-yl]methylamino]butanoic acid Traditional Name: 3-[[6-(4-phenylbutoxy)-3,4-dihydronaphthalen-2-yl]methylamino]butyric acid Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NCC1=CC2=C(CC1)C=C(C=C2)OCCCCC3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)O)NCC1=CC2=C(CC1)C=C(C=C2)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C25H31NO3/c1-19(15-25(27)28)26-18-21-10-11-23-17-24(13-12-22(23)16-21)29-14-6-5-9-20-7-3-2-4-8-20/h2-4,7-8,12-13,16-17,19,26H,5-6,9-11,14-15,18H2,1H3,(H,27,28)