methyl-[3-[(phenylmethyl)amino]-4-prop-2-enyl-naphthalen-1-yl]oxy-borinic acid

Systemtic Name: methyl-[3-[(phenylmethyl)amino]-4-prop-2-enyl-naphthalen-1-yl]oxy-borinic acid Openeye Name: [4-allyl-3-(benzylamino)-1-naphthyl]oxy-methyl-borinic acid CAS Name: methyl-[[3-[(phenylmethyl)amino]-4-prop-2-enyl-1-naphthalenyl]oxy]borinic acid IUPAC Name: [3-(benzylamino)-4-prop-2-enylnaphthalen-1-yl]oxy-methylborinic acid Traditional Name: [4-allyl-3-(benzylamino)-1-naphthoxy]-methyl-borinic acid Formula: C21H22BNO2 MolecularWeight: 331.21588

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(O)OC1=CC(=C(C2=CC=CC=C21)CC=C)NCC3=CC=CC=C3

Isomeric SMILES

B(C)(O)OC1=CC(=C(C2=CC=CC=C21)CC=C)NCC3=CC=CC=C3

InChI

InChI=1S/C21H22BNO2/c1-3-9-18-17-12-7-8-13-19(17)21(25-22(2)24)14-20(18)23-15-16-10-5-4-6-11-16/h3-8,10-14,23-24H,1,9,15H2,2H3